2,6-Di-t-butyl-4-selenocyanatophenol
TL;DR: 2,6-Di-t-butyl-4-selenocyanatophenol (CAS 97490-50-1) is a chemical compound with molecular formula C15H21NOSe and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-ditert-butyl-4-hydroxyphenyl) selenocyanate
Also Known As: 2,6-di-t-butyl-4-selenocyanatophenol, 2,6-di-tert-butyl-4-selenocyanatophenol, 4-selenocyanato-2,6-ditert-butyl-phenol, 3,5-di-tert-butyl-4-hydroxyphenyl selenocyanate, (3,5-ditert-butyl-4-hydroxyphenyl) selenocyanate
| Molecular Formula | C15H21NOSe |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 2.79778 |
| Topological Polar Surface Area | 44.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.07883 |
| Heavy Atoms | 18 |
| Complexity | 451.6809 |
Chemical Identifiers
| CAS Number | 97490-50-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[Se]C#N |
Product Overview
2,6-Di-t-butyl-4-selenocyanatophenol (CAS 97490-50-1), with molecular formula C15H21NOSe and molecular weight 311.08 g/mol. IUPAC: (3,5-ditert-butyl-4-hydroxyphenyl) selenocyanate.
Chemical Property Profile of 2,6-Di-t-butyl-4-selenocyanatophenol
Property Insights of 2,6-Di-t-butyl-4-selenocyanatophenol
The XLogP value of 2.79778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Di-t-butyl-4-selenocyanatophenol. With a topological polar surface area (TPSA) of 44.02 Ų, 2,6-Di-t-butyl-4-selenocyanatophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Di-t-butyl-4-selenocyanatophenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Di-t-butyl-4-selenocyanatophenol?
The CAS number of 2,6-Di-t-butyl-4-selenocyanatophenol is 97490-50-1.
What is the molecular formula of 2,6-Di-t-butyl-4-selenocyanatophenol?
The molecular formula of 2,6-Di-t-butyl-4-selenocyanatophenol is C15H21NOSe.
What is the molecular weight of 2,6-Di-t-butyl-4-selenocyanatophenol?
The molecular weight of 2,6-Di-t-butyl-4-selenocyanatophenol is 311.08 g/mol.
Where can I buy 2,6-Di-t-butyl-4-selenocyanatophenol?
You can request a quote for 2,6-Di-t-butyl-4-selenocyanatophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Di-t-butyl-4-selenocyanatophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Di-t-butyl-4-selenocyanatophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.